Glycoside
GD084133
Name:
NoneFormula:
C16H22O6NBrSmiles:
CC(C)(C(=O)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1ccc(Br)cc1Aglycone:
CC(C)(C(N)=O)c1ccc(Br)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -0.36 | Num_rotatable_bonds: | 4 |
| MolWt: | 404.26 | Num_heavy_atoms: | 24 |
| TPSA: | 119.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD37545
Formula: C10H12ONBr
Smiles:
CC(C)(C(N)=O)c1ccc(Br)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 2.21 | Num_rotatable_bonds: | 2 |
| MolWt: | 242.12 | Num_heavy_atoms: | 13 |
| TPSA: | 43.09 | NumAromaticRings: | 1 |
